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4'-O-Methyldesmodian B
SpectraBase Compound ID 5QSxKoCRc0B
InChI InChI=1S/C24H28O5/c1-12(2)20-10-18-23(29-20)14(4)22(27-6)17-9-15(11-28-24(17)18)16-7-8-19(25)13(3)21(16)26-5/h7-8,15,20,25H,1,9-11H2,2-6H3
InChIKey LPAVVDGLZFQJDF-UHFFFAOYSA-N
Mol Weight 396.48 g/mol
Molecular Formula C24H28O5
Exact Mass 396.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CsBU6EvetIT
Name 4'-O-Methyldesmodian B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O5
InChI InChI=1S/C24H28O5/c1-12(2)20-10-18-23(29-20)14(4)22(27-6)17-9-15(11-28-24(17)18)16-7-8-19(25)13(3)21(16)26-5/h7-8,15,20,25H,1,9-11H2,2-6H3
InChIKey LPAVVDGLZFQJDF-UHFFFAOYSA-N
Molecular Weight 396.483 g/mol
SMILES Oc1ccc(c(c1C)OC)C1COc2c(c(OC)c(c3c2CC(C(=C)C)O3)C)C1
SPLASH splash10-03ea-0933000000-b5b058a988b60c81a3b3
Source of Spectrum K1-0-5448-5
Wiley ID 1589907